UCSF

ZINC17159503

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 16th, 2008 34 No

Popular Name: (4E,5S)-4-[(4-ethoxyphenyl)-hydroxy-methylene]-1-(2-methoxyethyl)-5-(3,4,5-trimethoxyphenyl)pyrrolid (4E,5S)-4-[(4-ethoxyphenyl)-hydr…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.43 6.69 -59.71 0 9 -1 107 470.498 11 ↓
Mid Mid (pH 6-8) 2.43 6.9 -16.5 1 9 0 104 471.506 11 ↓
Mid Mid (pH 6-8) 1.84 7.26 -16.73 0 9 0 101 471.506 11 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )